1-[(2S)-butan-2-yl]-5-[(cyclopropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-[(2S)-butan-2-yl]-5-[(cyclopropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(cyclopropylamino)methylene]-1-[(1S)-1-methylpropyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-[(2S)-butan-2-yl]-5-[(cyclopropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-[(2S)-butan-2-yl]-5-[(cyclopropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(cyclopropylamino)methylene]-1-[(1S)-1-methylpropyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CNC2CC2)C(=O)NC1=S

Isomeric SMILES

CC[C@H](C)N1C(=O)C(=CNC2CC2)C(=O)NC1=S

InChI

InChI=1S/C12H17N3O2S/c1-3-7(2)15-11(17)9(6-13-8-4-5-8)10(16)14-12(15)18/h6-8,13H,3-5H2,1-2H3,(H,14,16,18)/t7-/m0/s1